4-[(E)-3-oxidanylidene-3-pyridin-4-yl-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-oxidanylidene-3-pyridin-4-yl-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-oxo-3-(4-pyridyl)prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-oxo-3-pyridin-4-ylprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-oxo-3-pyridin-4-ylprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-keto-3-(4-pyridyl)prop-1-enyl]benzoic acid Formula: C15H11NO3 MolecularWeight: 253.25274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=CC=NC=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=CC=NC=C2)C(=O)O

InChI

InChI=1S/C15H11NO3/c17-14(12-7-9-16-10-8-12)6-3-11-1-4-13(5-2-11)15(18)19/h1-10H,(H,18,19)/b6-3+